(Q105035639)

English

7-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,6-dimethoxychromen-4-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

flavone

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mass

668.195249692 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Jaceidin 7-neohesperidoside

1 reference

based on heuristic

inferred from InChIKey

chemical formula

C₃₀H₃₆O₁₇

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canonical SMILES

O=C1C(OC)=C(OC=2C=C(OC3OC(CO)C(O)C(O)C3OC4OC(C)C(O)C(O)C4O)C(OC)=C(O)C12)C=5C=CC(O)=C(OC)C5

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isomeric SMILES

COc1cc(-c2oc3cc(O[C@@H]4O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]4O[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O)c(OC)c(O)c3c(=O)c2OC)ccc1O

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found in taxon

Senna occidentalis

1 reference

stated in

Two Flavonoid Glycosides from Cassia occidentalis Pods

Identifiers

InChI

InChI=1S/C30H36O17/c1-10-18(33)22(37)24(39)29(43-10)47-28-23(38)19(34)16(9-31)46-30(28)45-15-8-14-17(20(35)26(15)41-3)21(36)27(42-4)25(44-14)11-5-6-12(32)13(7-11)40-2/h5-8,10,16,18-19,22-24,28-35,37-39H,9H2,1-4H3/t10-,16+,18+,19+,22+,23+,24-,28+,29+,30-/m1/s1

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InChIKey

HZEWHESQZMJCAC-LJCJCFAGSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HZEWHESQZMJCAC-LJCJCFAGSA-N

(Q105035639)

7-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,6-dimethoxychromen-4-one

Statements

Identifiers

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